N-benzyl-3-ethoxy-4-phenylmethoxybenzamide

C23H23NO3 — CID 2192321

IUPACN-benzyl-3-ethoxy-4-phenylmethoxybenzamide
SMILESCCOc1cc(C(=O)NCc2ccccc2)ccc1OCc1ccccc1
InChIInChI=1S/C23H23NO3/c1-2-26-22-15-20(23(25)24-16-18-9-5-3-6-10-18)13-14-21(22)27-17-19-11-7-4-8-12-19/h3-15H,2,16-17H2,1H3,(H,24,25)
InChIKeyPXGWNWZIFQRJCW-UHFFFAOYSA-N
MW361.44 g/mol
LogP4.59
Rot. Bonds8

About N-benzyl-3-ethoxy-4-phenylmethoxybenzamide

N-benzyl-3-ethoxy-4-phenylmethoxybenzamide (PubChem CID 2192321) has the molecular formula C23H23NO3 and a molecular weight of 361.44 g/mol. Its IUPAC name is N-benzyl-3-ethoxy-4-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-benzyl-3-ethoxy-4-phenylmethoxybenzamide
PubChem CID2192321
Molecular FormulaC23H23NO3
Molecular Weight361.44 g/mol
Exact Mass361.17
IUPAC NameN-benzyl-3-ethoxy-4-phenylmethoxybenzamide
SMILESCCOc1cc(C(=O)NCc2ccccc2)ccc1OCc1ccccc1
InChIInChI=1S/C23H23NO3/c1-2-26-22-15-20(23(25)24-16-18-9-5-3-6-10-18)13-14-21(22)27-17-19-11-7-4-8-12-19/h3-15H,2,16-17H2,1H3,(H,24,25)
InChIKeyPXGWNWZIFQRJCW-UHFFFAOYSA-N
XLogP4.59
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-3-ethoxy-4-propoxybenzamide
CID 4264811
3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide
CID 39508576
3-ethoxy-N-(4-methylphenyl)-4-phenylmethoxybenzamide
CID 126086097
3,4-diethoxy-N-[(2-ethoxyphenyl)methyl]benzamide
CID 71822422
3-ethoxy-N-(2-methoxyphenyl)-4-phenylmethoxybenzamide
CID 126087524
3-ethoxy-N-(3-hydroxyphenyl)-4-phenylmethoxybenzamide
CID 126089788
N-[[4-(diethylaminomethyl)phenyl]methyl]-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide
CID 43054762
3-ethoxy-4-(pyridin-3-ylmethoxy)-N-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]benzamide
CID 30838230
3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide
CID 46479176
3-fluoro-4-methoxy-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]benzamide
CID 8756994
N-(3-chlorophenyl)-3-ethoxy-4-phenylmethoxybenzamide
CID 2192184
3,4-diethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 41261631

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-ethoxy-4-phenylmethoxybenzamide?
The IUPAC name of N-benzyl-3-ethoxy-4-phenylmethoxybenzamide (CID 2192321) is N-benzyl-3-ethoxy-4-phenylmethoxybenzamide.
What is the SMILES notation for N-benzyl-3-ethoxy-4-phenylmethoxybenzamide?
The canonical SMILES for N-benzyl-3-ethoxy-4-phenylmethoxybenzamide is CCOc1cc(C(=O)NCc2ccccc2)ccc1OCc1ccccc1.
What is the InChIKey of N-benzyl-3-ethoxy-4-phenylmethoxybenzamide?
The InChIKey is PXGWNWZIFQRJCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO3/c1-2-26-22-15-20(23(25)24-16-18-9-5-3-6-10-18)13-14-21(22)27-17-19-11-7-4-8-12-19/h3-15H,2,16-17H2,1H3,(H,24,25).
What are the key properties of N-benzyl-3-ethoxy-4-phenylmethoxybenzamide?
N-benzyl-3-ethoxy-4-phenylmethoxybenzamide has a molecular weight of 361.44 g/mol, XLogP of 4.59, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-ethoxy-4-phenylmethoxybenzamide is sourced from PubChem (CID 2192321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).